Synthesis, Structure and Photoluminescence of a Cu2I2 Complex with an Acridine-modified Diimine Ligand  

作　　者：GUO You-Hong ZHAO Dong-Sheng SHI Yan-Fang ZHANG Ling-Ling YU Rong-Min 

机构地区：[1]College of Pharmaceutics,Quanzhou Medical College,Quanzhou 362000,China [2]State Key Laboratory of Structural Chemistry,Fujian Institute of Research on the Structure of Matter,Chinese Academy of Sciences,Fuzhou 350002,China

出　　处：《Chinese Journal of Structural Chemistry》2020年第7期1288-1294,共7页结构化学（英文）

基　　金：supported by the NSF 21671190。

摘　　要：A dinuclear cuprous complex[(mapypz)Cu(μ-I)2 Cu(mapypz)](1,mapypz=9,9-dimethyl-10-(6-(3-phenyl-1H-pyrazol-1-yl)-pyridin-3-yl)-9,10-dihydroacridine)was synthesized from the reaction of equivalent CuⅠand mapypz at room temperature.The compound crystallizes in monoclinic space group P21/c with a=13.8300(4),b=9.5365(2),c=19.0833(5)?,β=103.017(3)o,V=2452.23(11)?3,Z=2,Mr=1237.92,Dc=1.677 g/cm3,F(000)=1232,μ=11.334 mm^–1,GOOF=1.001,the final R=0.0330,and wR=0.0741 for 4627 observed reflections withⅠ>2σ(Ⅰ).The Cu(I)atoms in the complex are four-coordinated with a distorted tetrahedral coordination geometry.The copper centers in the molecular structure are bridged by two iodide anions and each Cu(I)is chelated further terminally by a diimine ligand.The[Cu(μ-I)2 Cu]core is planar.Ⅰn the solid state,the complex exhibits orange photoluminescence with emission peakλmax=568 nm,lifetimeτ=16μs and quantum yieldф=0.22 at room temperature.The studies of varied temperature emission spectra and decay behaviours of the complex indicate that it displays thermally activated delayed fluorescence at room temperature.The results of experimental and DFT calculations suggest that the emission in the solid state originates from the 1,3 MLCT excited states.

关 键 词：binuclear cuprous complex crystal structure emissive property DFT calculation 

分 类 号：O641.4[理学—物理化学]